Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:25:06 UTC
Update Date2025-03-25 00:41:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02121418
Frequency0.6
Structure
Chemical FormulaC4H8O3S
Molecular Mass136.0194
SMILESO=CSCC(O)CO
InChI KeyFAMKRSVYNWATIV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • carbothioic s-esters
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • sulfenyl compounds
  • thioesters
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • sulfenyl compound
  • thiocarboxylic acid ester
  • organosulfur compound
  • carboxylic acid derivative
  • carbothioic s-ester
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • thiolactone
  • organooxygen compound
  • 1,2-diol